4-(2-pyrrolidin-2-ylacetyl)piperazin-2-one;hydrochloride

C10H18ClN3O2 — CID 119681672

IUPAC4-(2-pyrrolidin-2-ylacetyl)piperazin-2-one;hydrochloride
SMILESCl.O=C1CN(C(=O)CC2CCCN2)CCN1
InChIInChI=1S/C10H17N3O2.ClH/c14-9-7-13(5-4-12-9)10(15)6-8-2-1-3-11-8;/h8,11H,1-7H2,(H,12,14);1H
InChIKeyWWQQLKVYGBFWRW-UHFFFAOYSA-N
MW247.73 g/mol
LogP-0.49
Rot. Bonds2

About 4-(2-pyrrolidin-2-ylacetyl)piperazin-2-one;hydrochloride

4-(2-pyrrolidin-2-ylacetyl)piperazin-2-one;hydrochloride (PubChem CID 119681672) has the molecular formula C10H18ClN3O2 and a molecular weight of 247.73 g/mol. Its IUPAC name is 4-(2-pyrrolidin-2-ylacetyl)piperazin-2-one;hydrochloride.

Molecular Properties

Compound Name4-(2-pyrrolidin-2-ylacetyl)piperazin-2-one;hydrochloride
PubChem CID119681672
Molecular FormulaC10H18ClN3O2
Molecular Weight247.73 g/mol
Exact Mass247.11
IUPAC Name4-(2-pyrrolidin-2-ylacetyl)piperazin-2-one;hydrochloride
SMILESCl.O=C1CN(C(=O)CC2CCCN2)CCN1
InChIInChI=1S/C10H17N3O2.ClH/c14-9-7-13(5-4-12-9)10(15)6-8-2-1-3-11-8;/h8,11H,1-7H2,(H,12,14);1H
InChIKeyWWQQLKVYGBFWRW-UHFFFAOYSA-N
XLogP-0.49
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.73
LogP ≤ 5-0.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-[2-(1,1-dioxo-1,4-thiazinan-3-yl)acetyl]piperazin-2-one
CID 80519900
1-(azocan-1-yl)-2-pyrrolidin-2-ylethanone
CID 61372180
4-(3-piperidin-2-ylpropanoyl)-1,4-diazepan-2-one
CID 65363828
2-pyrrolidin-2-yl-1-thiomorpholin-4-ylethanone;hydrochloride
CID 119705182
N-[[4-(3-oxopiperazine-1-carbonyl)phenyl]methyl]-2-pyrrolidin-2-ylacetamide
CID 119713198
2-[(2S)-piperidin-2-yl]-1-pyrrolidin-1-ylethanone
CID 29083930
1-(4-cyclobutylpiperazin-1-yl)-2-pyrrolidin-2-ylethanone;dihydrochloride
CID 119887210
2,2-dimethyl-1-[4-(2-pyrrolidin-2-ylacetyl)piperazin-1-yl]propan-1-one;hydrochloride
CID 119708849
4-(2-pyrrolidin-2-ylacetyl)piperazine-1-sulfonamide;hydrochloride
CID 119701502
1-[4-(2-oxo-2-pyrrolidin-1-ylethyl)piperazin-1-yl]-2-pyrrolidin-2-ylethanone;dihydrochloride
CID 119834001
1-(4-ethenylpiperidin-1-yl)-2-pyrrolidin-2-ylethanone;hydrochloride
CID 119783256
4-[2-(1,1-dioxothiolan-3-yl)acetyl]piperazin-2-one
CID 55023787

Frequently Asked Questions

What is the IUPAC name of 4-(2-pyrrolidin-2-ylacetyl)piperazin-2-one;hydrochloride?
The IUPAC name of 4-(2-pyrrolidin-2-ylacetyl)piperazin-2-one;hydrochloride (CID 119681672) is 4-(2-pyrrolidin-2-ylacetyl)piperazin-2-one;hydrochloride.
What is the SMILES notation for 4-(2-pyrrolidin-2-ylacetyl)piperazin-2-one;hydrochloride?
The canonical SMILES for 4-(2-pyrrolidin-2-ylacetyl)piperazin-2-one;hydrochloride is Cl.O=C1CN(C(=O)CC2CCCN2)CCN1.
What is the InChIKey of 4-(2-pyrrolidin-2-ylacetyl)piperazin-2-one;hydrochloride?
The InChIKey is WWQQLKVYGBFWRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O2.ClH/c14-9-7-13(5-4-12-9)10(15)6-8-2-1-3-11-8;/h8,11H,1-7H2,(H,12,14);1H.
What are the key properties of 4-(2-pyrrolidin-2-ylacetyl)piperazin-2-one;hydrochloride?
4-(2-pyrrolidin-2-ylacetyl)piperazin-2-one;hydrochloride has a molecular weight of 247.73 g/mol, XLogP of -0.49, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-pyrrolidin-2-ylacetyl)piperazin-2-one;hydrochloride is sourced from PubChem (CID 119681672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).